N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine

C50H34N4 — CID 118316092

IUPACN,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine
SMILESc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2ccc4ccn(-c5ccccc5)c4c2n3-c2ccccc2)cc1
InChIInChI=1S/C50H34N4/c1-5-15-36(16-6-1)51-32-31-35-25-28-43-45-34-41(27-30-48(45)54(50(43)49(35)51)39-21-11-4-12-22-39)52(37-17-7-2-8-18-37)40-26-29-47-44(33-40)42-23-13-14-24-46(42)53(47)38-19-9-3-10-20-38/h1-34H
InChIKeyRSJTVEGOCUEWER-UHFFFAOYSA-N
MW690.85 g/mol
LogP13.29
Rot. Bonds6

About N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine

N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine (PubChem CID 118316092) has the molecular formula C50H34N4 and a molecular weight of 690.85 g/mol. Its IUPAC name is N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine.

Molecular Properties

Compound NameN,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine
PubChem CID118316092
Molecular FormulaC50H34N4
Molecular Weight690.85 g/mol
Exact Mass690.28
IUPAC NameN,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine
SMILESc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2ccc4ccn(-c5ccccc5)c4c2n3-c2ccccc2)cc1
InChIInChI=1S/C50H34N4/c1-5-15-36(16-6-1)51-32-31-35-25-28-43-45-34-41(27-30-48(45)54(50(43)49(35)51)39-21-11-4-12-22-39)52(37-17-7-2-8-18-37)40-26-29-47-44(33-40)42-23-13-14-24-46(42)53(47)38-19-9-3-10-20-38/h1-34H
InChIKeyRSJTVEGOCUEWER-UHFFFAOYSA-N
XLogP13.29
TPSA18.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.85
LogP ≤ 513.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[9-(4-methylphenyl)carbazol-3-yl]-N,1,10-triphenylpyrrolo[2,3-a]carbazol-7-amine
CID 118316091
9-(4-methylphenyl)-N-phenyl-N-[4-(10-phenylpyrrolo[2,3-a]carbazol-1-yl)phenyl]carbazol-3-amine
CID 118316037
9-(4-methylphenyl)-N-phenyl-N-[4-(1-phenylpyrrolo[2,3-a]carbazol-10-yl)phenyl]carbazol-3-amine
CID 118315164
N,9-bis(4-methylphenyl)-N-[3-(1-phenylpyrrolo[2,3-a]carbazol-10-yl)phenyl]carbazol-3-amine
CID 118315166
5,8-bis(4-carbazol-9-ylphenyl)-5,8-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2(6),3,7(11),9,12,14-heptaene;9-[4-[1-(4-carbazol-9-ylphenyl)pyrrolo[3,2-g]indol-8-yl]phenyl]carbazole;N,N-diphenyl-4-[8-[4-(N-phenylanilino)phenyl]-5,8-diazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2(6),3,7(11),9,12,14-heptaen-5-yl]aniline;N,N-diphenyl-4-[1-[4-(N-phenylanilino)phenyl]pyrrolo[3,2-g]indol-8-yl]aniline
CID 161495857
1,10-diphenyl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-2-ylphenyl)pyrrolo[2,3-a]carbazol-7-amine
CID 90060886
1,10-diphenyl-N-(4-pyrimidin-2-ylphenyl)-N-[4-(1,3,5-triazin-2-yl)phenyl]pyrrolo[2,3-a]carbazol-7-amine
CID 90061123
N,9-diphenyl-N-[3-[3-(4-phenylphenyl)pyrrolo[3,2-a]carbazol-10-yl]phenyl]carbazol-3-amine
CID 118315481
N-[4-(1,3-diphenylpyrrolo[2,3-a]carbazol-10-yl)phenyl]-N,9-bis(4-methylphenyl)carbazol-3-amine
CID 118315805
N-chrysen-2-yl-N,9-diphenylcarbazol-3-amine
CID 170138733
4-methyl-N-(4-methylphenyl)-N-[4-(1-phenylpyrrolo[3,2-c]carbazol-6-yl)phenyl]aniline
CID 118315359
15-phenyl-9-(9-phenylcarbazol-3-yl)-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,18]icosa-1(13),2(10),3,5,7,11,14(18),16,19-nonaene
CID 144645343

Frequently Asked Questions

What is the IUPAC name of N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine?
The IUPAC name of N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine (CID 118316092) is N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine.
What is the SMILES notation for N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine?
The canonical SMILES for N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine is c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2ccc4ccn(-c5ccccc5)c4c2n3-c2ccccc2)cc1.
What is the InChIKey of N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine?
The InChIKey is RSJTVEGOCUEWER-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H34N4/c1-5-15-36(16-6-1)51-32-31-35-25-28-43-45-34-41(27-30-48(45)54(50(43)49(35)51)39-21-11-4-12-22-39)52(37-17-7-2-8-18-37)40-26-29-47-44(33-40)42-23-13-14-24-46(42)53(47)38-19-9-3-10-20-38/h1-34H.
What are the key properties of N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine?
N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine has a molecular weight of 690.85 g/mol, XLogP of 13.29, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,10-triphenyl-N-(9-phenylcarbazol-3-yl)pyrrolo[2,3-a]carbazol-7-amine is sourced from PubChem (CID 118316092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).